Methyl(purin-6-yl)amine
fo-c43f440895733060
Identity
- Type
- Neutral molecule
- CAS
- 443-72-1
- EC
- 207-137-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
17- 1H-Purin-6-amine, N-methyl-
- 6-(Methylamino)purine
- 6-(N-Methylamino)purine
- 6-MAP
- 6-MAP (methyladenine)
- 6-Methyladenine
- 6-Methylaminopurine
- 6-Mono(methylamino)purine
- 6-N-Methyladenine
- 9H-Purin-6-amine, N-methyl-
- Adenine, N-methyl-
- N-Methyl-6-aminopurine
- N-methyl-9H-purin-6-amine
- N6-Methyladenine
- N6-Methylaminopurine
- N6-Monomethyladenine
- NCI ID: NSC 11580
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | CKOMXBHMKXXTNW-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H7N5/c1-7-5-4-6(10-2-8-4)11-3-9-5/h2-3H,1H3,(H2,7,8,9,10,11) |
| IUPAC name chemrof:IUPAC_name | Methyl(purin-6-yl)amine |
| Molecular formula chemrof:molecular_formula | C6H7N5 |
| Molecular mass chemrof:molecular_mass | 149.157 |
| Monoisotopic mass chemrof:monoisotopic_mass | 149.070145, 149.07015 |
| SMILES string chemrof:smiles_string | CNc1ncnc2nc[nH]c12 |
Known URLs
23Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=443-72-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28871 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.006.490 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1020857 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=11580 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1738843 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W7IBY2BGAX | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0002099 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J128.125I | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C08434 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C08434 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=38021 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:N6M | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/67955 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=021655 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23547775 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25936836 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26158636 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26211457 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26293475 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/7433124 | enrich_references.chebi_xrefs |
| reaxys | reaxys:610040 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q15632800 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 247e1da9-7ba6-446b-b3ea-19b2c3fa15fd | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| 977a7fc0-a88a-484d-b07d-f259c64265d5 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 77e6e848-d28a-4585-bec3-fea5818a44e7 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| ceae513a-bc1f-409a-ac66-220b030ed3dc | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| e80f1eab-d09e-4f90-968a-cb02d67107b9 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| 7cac4565-22f9-4d5a-8971-f87060e23e77 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| 0427d2dd-787c-4b69-a2a3-6769eda9b1c3 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| ed7774da-2a8a-4991-9708-b159168a7247 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| ef829402-0646-43b6-9992-469ef7d7912c | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| e733be4e-175c-4896-9ece-2886bad9ead5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 8532daf5-ab40-4a9f-9178-653712b6f289 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| 444dadc5-787d-4fee-b8dd-9b05bc2b9a8b | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| 6f41abe4-88fb-4845-93f4-28b4b47493a5 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works